Methanol → 1-[5-(5-Chloro-thiophen-2-yl)-isoxazol-3-ylmethyl]-2-(1-isopropyl-piperidin-4-ylcarbamoyl)-1H-benzoimidazole-5-carboxylic acid
Reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([n:9]([CH2:24][c:25]3[n:26][o:27][c:28](-[c:30]4[s:31][c:32]([Cl:35])[cH:33][cH:34]4)[cH:29]3)[c:10]([C:12]([NH:13][CH:14]3[CH2:15][CH2:16][N:17]([CH:20]([CH3:21])[CH3:22])[CH2:18][CH2:19]3)=[O:23])[n:11]2)[cH:36][cH:37]1.[CH3:38][OH:39]>>[O:2]=[C:3]([OH:4])[c:5]1[cH:6][c:7]2[c:8]([n:9]([CH2:24][c:25]3[n:26][o:27][c:28](-[c:30]4[s:31][c:32]([Cl:35])[cH:33][cH:34]4)[cH:29]3)[c:10]([C:12]([NH:13][CH:14]3[CH2:15][CH2:16][N:17]([CH:20]([CH3:21])[CH3:22])[CH2:18][CH2:19]3)=[O:23])[n:11]2)[cH:36][cH:37]1Participants
3
Sources & evidence
- ORD record
- ord-fa3477a985cd4768ba66560c529256a3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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